1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine

C17H34N2 — CID 114544504

IUPAC1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine
SMILESCC1CCC(NC2(CN)CC(C)(C)CC(C)(C)C2)C1
InChIInChI=1S/C17H34N2/c1-13-6-7-14(8-13)19-17(12-18)10-15(2,3)9-16(4,5)11-17/h13-14,19H,6-12,18H2,1-5H3
InChIKeyMEGKEECRQPDICZ-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.70
Rot. Bonds3

About 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine

1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine (PubChem CID 114544504) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine
PubChem CID114544504
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine
SMILESCC1CCC(NC2(CN)CC(C)(C)CC(C)(C)C2)C1
InChIInChI=1S/C17H34N2/c1-13-6-7-14(8-13)19-17(12-18)10-15(2,3)9-16(4,5)11-17/h13-14,19H,6-12,18H2,1-5H3
InChIKeyMEGKEECRQPDICZ-UHFFFAOYSA-N
XLogP3.70
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine?
The IUPAC name of 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine (CID 114544504) is 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine?
The canonical SMILES for 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine is CC1CCC(NC2(CN)CC(C)(C)CC(C)(C)C2)C1.
What is the InChIKey of 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine?
The InChIKey is MEGKEECRQPDICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-13-6-7-14(8-13)19-17(12-18)10-15(2,3)9-16(4,5)11-17/h13-14,19H,6-12,18H2,1-5H3.
What are the key properties of 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine?
1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-3,3,5,5-tetramethyl-N-(3-methylcyclopentyl)cyclohexan-1-amine is sourced from PubChem (CID 114544504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).